ethyl (E)-3-[2-(2-methoxy-2-oxidanylidene-ethyl)-11-oxidanylidene-6H-benzo[c][1]benzoxepin-9-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-(2-methoxy-2-oxidanylidene-ethyl)-11-oxidanylidene-6H-benzo[c][1]benzoxepin-9-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-(2-methoxy-2-oxo-ethyl)-11-oxo-6H-benzo[c][1]benzoxepin-9-yl]prop-2-enoate CAS Name: (E)-3-[2-(2-methoxy-2-oxoethyl)-11-oxo-6H-benzo[c][1]benzoxepin-9-yl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(2-methoxy-2-oxoethyl)-11-oxo-6H-benzo[c][1]benzoxepin-9-yl]prop-2-enoate Traditional Name: (E)-3-[11-keto-2-(2-keto-2-methoxy-ethyl)-6H-benzo[c][1]benzoxepin-9-yl]acrylic acid ethyl ester Formula: C22H20O6 MolecularWeight: 380.3906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC2=C(COC3=C(C2=O)C=C(C=C3)CC(=O)OC)C=C1

Isomeric SMILES

CCOC(=O)/C=C/C1=CC2=C(COC3=C(C2=O)C=C(C=C3)CC(=O)OC)C=C1

InChI

InChI=1S/C22H20O6/c1-3-27-20(23)9-6-14-4-7-16-13-28-19-8-5-15(12-21(24)26-2)11-18(19)22(25)17(16)10-14/h4-11H,3,12-13H2,1-2H3/b9-6+